Known targets — ChEMBL curated mechanism
ADRB1ADRB2ATP4AATP4BAXLCHRM2CHRM3DRD2FLT3HRH1HTR2AHTR2BHTR2CKCNH2KMT2AMAP2K1MAP2K2MEN1MLNRPLK4RENS1PR1SLC6A2SLC6A4atpAatpBatpCatpDatpEatpFatpFHatpGpol
The experimentally established mechanism targets of Fumaric Acid. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH1 known ✓ | P35367 | 5/20 | 0.49 |
| ▸ | KCNH2 known ✓ | Q12809 | 1/20 | 0.39 |
| ▸ | SLC6A2 known ✓ | P23975 | 5/20 | 0.38 |
| ▸ | SLC6A4 known ✓ | P31645 | 5/20 | 0.38 |
| ▸ | MLNR known ✓ | O43193 | 1/20 | 0.35 |
| ▸ | CACNA1B | Q00975 | 1/20 | 0.46 |
| ▸ | GRK6 | P43250 | 1/20 | 0.39 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.36 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.35 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| Fumaric Acid SCHEMBL9013897 | 1.00 | HRH1 (0.49) | HRH1CACNA1BKCNH2GRK6SLC6A2 | |
| Fumaric Acid SCHEMBL9013968 | 0.84 | HRH1 (0.53) | HRH1KCNH2GRK6SLC6A2SLC6A4 | |
| Fumaric Acid SCHEMBL9013975 | 0.84 | HRH1 (0.53) | HRH1KCNH2GRK6SLC6A2SLC6A4 | |
| SCHEMBL9013895 | 0.77 | KMT2A (0.38) | HRH3 | |
| Fumaric Acid SCHEMBL9013889 | 0.73 | RAB9A (0.50) | HRH1KCNH2HRH3 | |
| SCHEMBL9014043 | 0.73 | GPR119 (0.54) | HRH3 | |
| SCHEMBL9022301 | 0.71 | HRH1 (0.59) | HRH1KCNH2HRH3 | |
| Fumaric Acid SCHEMBL9013804 | 0.70 | HRH1 (0.51) | HRH1KCNH2HRH3 | |
| Fumaric Acid SCHEMBL9013794 | 0.70 | HRH1 (0.51) | HRH1KCNH2HRH3 | |
| Fumaric Acid SCHEMBL9014052 | 0.70 | HRH1 (0.48) | HRH1KCNH2GRK6SLC6A2SLC6A4 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5580883-A | INHIBITING DEGENERATION AND NECROCYTOSIS OF CEREBRAL NERVE CELLS CAUSED BY OXIDATIVE STRESS INDUCING GLUTAMIC ACID IN MAMMALS | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1996-12-03 | — | — | US | disclosed |
| EP-0449195-A2 | Aminobenzene compounds, their production and use | Takeda Chemical Industries, Ltd. (JP) | 1991-10-02 | — | — | EP | disclosed |